Berlin 2018 –
wissenschaftliches Programm
MM 14: Focus Session: Frontiers of Electronic-Structure Theory: Correlated Electron Materials II (joint session O/MM/DS/TT/CPP)
Montag, 12. März 2018, 15:00–17:15, HL 001
Organizers: Silke Biermann, Ecole Polytechnique, Palaiseau cedex, France;
Paul R. Kent, Oak Ridge National Laboratory, USA;
Matthias Scheffler, Fritz-Haber-Institut der Max-Planck-Gesellschaft, Berlin
(Synopsis provided with part I of this session)
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15:00 |
MM 14.1 |
Non-adiabatic Dynamics in Single-Electron Tunneling Devices with Time-Dependent Density Functional Theory — •Niklas Dittmann, Janine Splettstoesser, and Nicole Helbig
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15:15 |
MM 14.2 |
Dissipative exchange-correlation functional in QED-TDDFT — •Camilla Pellegrini, Ilya Tokatly, and Angel Rubio
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15:30 |
MM 14.3 |
Electric and magnetic response properties of solids from the current density — •Rubén Rodríguez Ferradás, Pina Romaniello, and Arjan Berger
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15:45 |
MM 14.4 |
Coupling Maxwell’s equations to the time-dependent Kohn-Sham equations: near-field effects and electromagnetic backreaction — •Rene Jestaedt, Micael Oliveira, Angel Rubio, and Heiko Appel
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16:00 |
MM 14.5 |
Enhanching excitation energy and charge transfer with strongly correlated light-matter interaction — •Christian Schäfer, Michael Ruggenthaler, Heiko Appel, and Angel Rubio
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16:15 |
MM 14.6 |
Effects of electronic correlations on the magnetic properties of organometallic molecules — •Sumanta Bhandary and Silke Biermann
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16:30 |
MM 14.7 |
Structural, electronic and optical properties of cubic and tetragonal SrTiO3: a DFT study including many-body effects — •Vijaya Begum, Markus E. Gruner, and Rossitza Pentcheva
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16:45 |
MM 14.8 |
Unveiling the mysterious magnetic state of superconducting iron under pressure — •Matteo d’Astuto
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17:00 |
MM 14.9 |
Frist-principle and experimental characterisation of the electronic properties of CaGaSiN3 and CaAlSiN3: impact of chemical disorder — •Jan Minar, Ondrej Sipr, Robin Niklaus, Jonas Hausler, and Wolfgang Scgnick
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